# electronic Ligand Builder and Optimisation Workbench (eLBOW)
#   - a module of PHENIX version dev-svn-
#   - file written: Sat Apr 11 17:32:58 2020
#   Inital geometry file: a 144 line input string
#   Ligand name: 1-[2-[5-[(3-methyloxetan-3-yl)methoxy]benzimidazol-1-yl]quinolin-8-yl]piperidin-4-amine
#   Quantum optimisation: True
#   Method: PBEh-3c
#   Random seed: 3628800
#   SMILES string: CC1(COC1)COc2ccc3n(cnc3c2)c4ccc5cccc(N6CCC(N)CC6)c5n4
#
data_comp_list
loop_
_chem_comp.id
_chem_comp.three_letter_code
_chem_comp.name
_chem_comp.group
_chem_comp.number_atoms_all
_chem_comp.number_atoms_nh
_chem_comp.desc_level
_chem_comp.initial_date
_chem_comp.modified_date
_chem_comp.source
 6T2  6T2  1-[2-[5-[(3-methyloxetan-3-yl)methoxy]benzimidazol-1-yl]quinolin-8-yl]piperidin-4-amine  ligand  62  33  .  2021-08-05  2022-09-22
;
Directly from eLBOW using geometry from QM method PBEh-3c with CPCM solvent model
Validated by Mogul as PERFECT
;

data_comp_6T2
loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
_chem_comp_atom.partial_charge
_chem_comp_atom.x
_chem_comp_atom.y
_chem_comp_atom.z
 6T2  C1   C  CR15  0   0.117   0.8455  -3.8240  -0.8403
 6T2  C2   C  CR6   0   0.510   2.4694  -2.0813  -0.1598
 6T2  C3   C  CR16  0  -0.377   3.5565  -2.9732  -0.0029
 6T2  C4   C  CR16  0  -0.182   4.7753  -2.4307   0.2738
 6T2  C5   C  CH2   0  -0.168  -4.4337   0.3952   0.2059
 6T2  C6   C  CR66  0   0.082   4.9282  -1.0310   0.4055
 6T2  C7   C  CR66  0   0.175   3.7744  -0.2368   0.2085
 6T2  C9   C  CR56  0   0.306  -0.0196  -1.8903  -0.2339
 6T2  C10  C  CR56  0   0.134  -1.0082  -2.8190  -0.5905
 6T2  C11  C  CR6   0   0.307   3.8589   1.1865   0.3323
 6T2  C12  C  CR16  0  -0.433  -2.3552  -2.4857  -0.5386
 6T2  C13  C  CR6   0   0.393  -2.6954  -1.2060  -0.1176
 6T2  C14  C  CR16  0  -0.354   5.0735   1.7282   0.6979
 6T2  C15  C  CR16  0  -0.247   6.2099   0.9262   0.9188
 6T2  C30  C  CH2   0  -0.316   2.6813   3.2626   0.7497
 6T2  C40  C  CH2   0  -0.426   1.2738   3.8385   0.7228
 6T2  C50  C  CH1   0  -0.089   0.7550   3.9593  -0.7028
 6T2  N80  N  NH2   0  -0.786  -0.5873   4.5226  -0.7060
 6T2  C60  C  CH2   0  -0.453   0.8738   2.6024  -1.3931
 6T2  C70  C  CH2   0  -0.301   2.2711   2.0157  -1.2772
 6T2  N4   N  NT    0  -0.486   2.7083   1.9549   0.1178
 6T2  N3   N  N     0  -0.462   2.5776  -0.7920  -0.0685
 6T2  C16  C  CR16  0  -0.342   6.1535  -0.4305   0.7616
 6T2  N1   N  NR5   0  -0.627   1.1798  -2.5722  -0.3978
 6T2  N2   N  N     0  -0.460  -0.4284  -4.0122  -0.9692
 6T2  C19  C  CR16  0  -0.264  -0.3521  -0.6140   0.1931
 6T2  C18  C  CR16  0  -0.388  -1.6983  -0.2860   0.2470
 6T2  O1   O  O2    0  -0.478  -4.0157  -0.9227  -0.0851
 6T2  C23  C  C     0  -0.197  -5.9405   0.4558   0.0607
 6T2  C27  C  CH3   0  -0.660  -6.4041   0.0874  -1.3359
 6T2  C24  C  C     0  -0.123  -6.5042   1.7628   0.6420
 6T2  O2   O  O     0  -0.511  -7.0733   1.0787   1.7638
 6T2  C26  C  C     0  -0.119  -6.7032  -0.1976   1.2249
 6T2  H1   H  HCR5  0   0.302   1.5989  -4.5620  -1.0708
 6T2  H2   H  HCR6  0   0.290   3.4336  -4.0446  -0.0688
 6T2  H3   H  HCR6  0   0.278   5.6336  -3.0750   0.4167
 6T2  H4   H  HCH2  0   0.232  -4.1378   0.6789   1.2241
 6T2  H5   H  HCH2  0   0.232  -3.9721   1.1123  -0.4855
 6T2  H6   H  HCR6  0   0.263  -3.1198  -3.1999  -0.8176
 6T2  H7   H  HCR6  0   0.269   5.1776   2.7991   0.8103
 6T2  H8   H  HCR6  0   0.261   7.1387   1.4033   1.2024
 6T2  H9   H  HCH2  0   0.203   3.3656   3.9743   0.2593
 6T2  H10  H  HCH2  0   0.250   3.0176   3.1596   1.7829
 6T2  H11  H  HCH2  0   0.214   0.6090   3.1900   1.3045
 6T2  H12  H  HCH2  0   0.236   1.2785   4.8175   1.2071
 6T2  H13  H  HCH1  0   0.214   1.4030   4.6685  -1.2328
 6T2  H14  H  HNH2  0   0.343  -0.9039   4.6299  -1.6625
 6T2  H15  H  HNH2  0   0.327  -1.2290   3.8590  -0.2851
 6T2  H17  H  HCH2  0   0.214   0.1520   1.9103  -0.9482
 6T2  H18  H  HCH2  0   0.234   0.6150   2.6940  -2.4516
 6T2  H19  H  HCH2  0   0.257   2.2803   1.0142  -1.7019
 6T2  H20  H  HCH2  0   0.210   2.9743   2.6282  -1.8643
 6T2  H21  H  HCR6  0   0.258   7.0269  -1.0504   0.9212
 6T2  H22  H  HCR6  0   0.286   0.4015   0.1111   0.4612
 6T2  H23  H  HCR6  0   0.270  -1.9615   0.7075   0.5829
 6T2  H24  H  HCH3  0   0.241  -6.1816  -0.9538  -1.5683
 6T2  H25  H  HCH3  0   0.234  -7.4814   0.2259  -1.4350
 6T2  H26  H  HCH3  0   0.232  -5.9173   0.7107  -2.0885
 6T2  H27  H  H     0   0.221  -5.7688   2.5189   0.9368
 6T2  H28  H  H     0   0.218  -7.2616   2.2416   0.0133
 6T2  H29  H  H     0   0.215  -7.5734  -0.7857   0.9155
 6T2  H30  H  H     0   0.221  -6.1088  -0.7931   1.9241

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_neutron
 6T2  O2   C26  single    1.434  0.020  1.434
 6T2  O2   C24  single    1.432  0.020  1.432
 6T2  C26  C23  single    1.538  0.020  1.538
 6T2  C24  C23  single    1.538  0.020  1.538
 6T2  C23  C5   single    1.515  0.020  1.515
 6T2  C23  C27  single    1.517  0.020  1.517
 6T2  C5   O1   single    1.413  0.020  1.413
 6T2  N80  C50  single    1.456  0.020  1.456
 6T2  O1   C13  single    1.351  0.020  1.351
 6T2  C40  C50  single    1.522  0.020  1.522
 6T2  C40  C30  single    1.521  0.020  1.521
 6T2  C13  C18  aromatic  1.405  0.020  1.405
 6T2  C13  C12  aromatic  1.389  0.020  1.389
 6T2  C18  C19  aromatic  1.387  0.020  1.387
 6T2  C50  C60  single    1.527  0.020  1.527
 6T2  C12  C10  aromatic  1.389  0.020  1.389
 6T2  C19  C9   aromatic  1.386  0.020  1.386
 6T2  C30  N4   single    1.453  0.020  1.453
 6T2  C10  C9   aromatic  1.402  0.020  1.402
 6T2  C10  N2   aromatic  1.380  0.020  1.380
 6T2  C60  C70  single    1.520  0.020  1.520
 6T2  C9   N1   aromatic  1.389  0.020  1.389
 6T2  N4   C70  single    1.463  0.020  1.463
 6T2  N4   C11  single    1.400  0.020  1.400
 6T2  N2   C1   aromatic  1.294  0.020  1.294
 6T2  N1   C1   aromatic  1.369  0.020  1.369
 6T2  N1   C2   single    1.400  0.020  1.400
 6T2  N3   C2   aromatic  1.297  0.020  1.297
 6T2  N3   C7   aromatic  1.348  0.020  1.348
 6T2  C11  C7   aromatic  1.431  0.020  1.431
 6T2  C11  C14  aromatic  1.379  0.020  1.379
 6T2  C2   C3   aromatic  1.415  0.020  1.415
 6T2  C7   C6   aromatic  1.414  0.020  1.414
 6T2  C14  C15  aromatic  1.408  0.020  1.408
 6T2  C3   C4   aromatic  1.362  0.020  1.362
 6T2  C6   C4   aromatic  1.414  0.020  1.414
 6T2  C6   C16  aromatic  1.410  0.020  1.410
 6T2  C15  C16  aromatic  1.367  0.020  1.367
 6T2  C1   H1   single    0.930  0.020  1.080
 6T2  C3   H2   single    0.930  0.020  1.080
 6T2  C4   H3   single    0.930  0.020  1.080
 6T2  C5   H4   single    0.970  0.020  1.090
 6T2  C5   H5   single    0.970  0.020  1.090
 6T2  C12  H6   single    0.930  0.020  1.080
 6T2  C14  H7   single    0.930  0.020  1.080
 6T2  C15  H8   single    0.930  0.020  1.080
 6T2  C30  H9   single    0.970  0.020  1.090
 6T2  C30  H10  single    0.970  0.020  1.090
 6T2  C40  H11  single    0.970  0.020  1.090
 6T2  C40  H12  single    0.970  0.020  1.090
 6T2  C50  H13  single    0.970  0.020  1.090
 6T2  N80  H14  single    0.890  0.020  1.040
 6T2  N80  H15  single    0.890  0.020  1.040
 6T2  C60  H17  single    0.970  0.020  1.090
 6T2  C60  H18  single    0.970  0.020  1.090
 6T2  C70  H19  single    0.970  0.020  1.090
 6T2  C70  H20  single    0.970  0.020  1.090
 6T2  C16  H21  single    0.930  0.020  1.080
 6T2  C19  H22  single    0.930  0.020  1.080
 6T2  C18  H23  single    0.930  0.020  1.080
 6T2  C27  H24  single    0.970  0.020  1.090
 6T2  C27  H25  single    0.970  0.020  1.090
 6T2  C27  H26  single    0.970  0.020  1.090
 6T2  C24  H27  single    0.970  0.020  1.090
 6T2  C24  H28  single    0.970  0.020  1.090
 6T2  C26  H29  single    0.970  0.020  1.090
 6T2  C26  H30  single    0.970  0.020  1.090

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
 6T2  H1   C1   N2   124.49  3.000
 6T2  H1   C1   N1   121.58  3.000
 6T2  N2   C1   N1   113.92  3.000
 6T2  N1   C2   N3   115.93  3.000
 6T2  N3   C2   C3   123.69  3.000
 6T2  N1   C2   C3   120.36  3.000
 6T2  H2   C3   C4   120.60  3.000
 6T2  H2   C3   C2   122.07  3.000
 6T2  C4   C3   C2   117.31  3.000
 6T2  H3   C4   C6   119.41  3.000
 6T2  H3   C4   C3   119.94  3.000
 6T2  C6   C4   C3   120.65  3.000
 6T2  H5   C5   H4   107.58  3.000
 6T2  H5   C5   C23  109.37  3.000
 6T2  H4   C5   C23  110.28  3.000
 6T2  H5   C5   O1   110.81  3.000
 6T2  H4   C5   O1   110.63  3.000
 6T2  C23  C5   O1   108.17  3.000
 6T2  C16  C6   C7   120.32  3.000
 6T2  C16  C6   C4   122.60  3.000
 6T2  C7   C6   C4   117.04  3.000
 6T2  N3   C7   C11  118.67  3.000
 6T2  C11  C7   C6   119.88  3.000
 6T2  N3   C7   C6   121.44  3.000
 6T2  C19  C9   N1   134.05  3.000
 6T2  N1   C9   C10  104.68  3.000
 6T2  C19  C9   C10  121.26  3.000
 6T2  N2   C10  C12  128.72  3.000
 6T2  N2   C10  C9   110.26  3.000
 6T2  C12  C10  C9   121.02  3.000
 6T2  N4   C11  C14  123.29  3.000
 6T2  C14  C11  C7   117.74  3.000
 6T2  N4   C11  C7   118.95  3.000
 6T2  H6   C12  C13  120.84  3.000
 6T2  H6   C12  C10  121.13  3.000
 6T2  C13  C12  C10  118.03  3.000
 6T2  O1   C13  C18  123.38  3.000
 6T2  C18  C13  C12  120.53  3.000
 6T2  O1   C13  C12  116.09  3.000
 6T2  H7   C14  C15  118.02  3.000
 6T2  H7   C14  C11  120.06  3.000
 6T2  C15  C14  C11  121.91  3.000
 6T2  H8   C15  C16  120.21  3.000
 6T2  H8   C15  C14  118.86  3.000
 6T2  C16  C15  C14  120.92  3.000
 6T2  H10  C30  H9   106.91  3.000
 6T2  H10  C30  N4   108.73  3.000
 6T2  H9   C30  N4   112.09  3.000
 6T2  H10  C30  C40  109.73  3.000
 6T2  H9   C30  C40  108.80  3.000
 6T2  N4   C30  C40  110.51  3.000
 6T2  H12  C40  H11  107.32  3.000
 6T2  H12  C40  C50  110.22  3.000
 6T2  H11  C40  C50  109.72  3.000
 6T2  H12  C40  C30  109.12  3.000
 6T2  H11  C40  C30  109.15  3.000
 6T2  C50  C40  C30  111.23  3.000
 6T2  H13  C50  C60  108.06  3.000
 6T2  H13  C50  N80  107.07  3.000
 6T2  C60  C50  N80  114.49  3.000
 6T2  H13  C50  C40  107.61  3.000
 6T2  C60  C50  C40  109.05  3.000
 6T2  N80  C50  C40  110.31  3.000
 6T2  H15  N80  H14  105.27  3.000
 6T2  H15  N80  C50  109.22  3.000
 6T2  H14  N80  C50  109.34  3.000
 6T2  H18  C60  H17  106.88  3.000
 6T2  H18  C60  C70  108.88  3.000
 6T2  H17  C60  C70  109.34  3.000
 6T2  H18  C60  C50  110.17  3.000
 6T2  H17  C60  C50  109.08  3.000
 6T2  C70  C60  C50  112.34  3.000
 6T2  H20  C70  H19  107.36  3.000
 6T2  H20  C70  N4   109.89  3.000
 6T2  H19  C70  N4   109.36  3.000
 6T2  H20  C70  C60  109.36  3.000
 6T2  H19  C70  C60  109.48  3.000
 6T2  N4   C70  C60  111.31  3.000
 6T2  C70  N4   C30  111.83  3.000
 6T2  C70  N4   C11  114.48  3.000
 6T2  C30  N4   C11  116.27  3.000
 6T2  C7   N3   C2   119.86  3.000
 6T2  H21  C16  C15  121.20  3.000
 6T2  H21  C16  C6   119.62  3.000
 6T2  C15  C16  C6   119.17  3.000
 6T2  C9   N1   C2   127.08  3.000
 6T2  C2   N1   C1   126.89  3.000
 6T2  C9   N1   C1   106.03  3.000
 6T2  C10  N2   C1   105.10  3.000
 6T2  H22  C19  C18  120.61  3.000
 6T2  H22  C19  C9   121.83  3.000
 6T2  C18  C19  C9   117.56  3.000
 6T2  H23  C18  C19  117.76  3.000
 6T2  H23  C18  C13  120.63  3.000
 6T2  C19  C18  C13  121.61  3.000
 6T2  C13  O1   C5   119.32  3.000
 6T2  C26  C23  C24   83.86  3.000
 6T2  C24  C23  C27  116.26  3.000
 6T2  C26  C23  C27  116.25  3.000
 6T2  C27  C23  C5   112.49  3.000
 6T2  C24  C23  C5   111.25  3.000
 6T2  C26  C23  C5   113.82  3.000
 6T2  H26  C27  H25  107.78  3.000
 6T2  H26  C27  H24  107.91  3.000
 6T2  H25  C27  H24  107.68  3.000
 6T2  H26  C27  C23  111.08  3.000
 6T2  H25  C27  C23  110.77  3.000
 6T2  H24  C27  C23  111.46  3.000
 6T2  H28  C24  H27  108.50  3.000
 6T2  H28  C24  O2   112.58  3.000
 6T2  H27  C24  O2   112.70  3.000
 6T2  H28  C24  C23  114.10  3.000
 6T2  H27  C24  C23  116.25  3.000
 6T2  O2   C24  C23   92.05  3.000
 6T2  C26  O2   C24   91.62  3.000
 6T2  H30  C26  H29  108.67  3.000
 6T2  H30  C26  O2   112.62  3.000
 6T2  H29  C26  O2   112.28  3.000
 6T2  H30  C26  C23  116.47  3.000
 6T2  H29  C26  C23  114.11  3.000
 6T2  O2   C26  C23   91.97  3.000

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
 6T2  CONST_01  C12  C10  N2   C1    180.00   0.0  0
 6T2  CONST_02  C9   C10  N2   C1      0.00   0.0  0
 6T2  CONST_03  C19  C9   N1   C1    180.00   0.0  0
 6T2  CONST_04  C10  C9   N1   C1      0.00   0.0  0
 6T2  CONST_07  C19  C9   N1   C2      0.00   0.0  0
 6T2  CONST_08  C10  C9   N1   C2    180.00   0.0  0
 6T2  CONST_09  N2   C1   N1   C2    180.00   0.0  0
 6T2  CONST_10  C11  C7   N3   C2    180.00   0.0  0
 6T2  CONST_11  C6   C7   N3   C2      0.00   0.0  0
 6T2  CONST_12  C6   C4   C3   C2      0.00   0.0  0
 6T2  CONST_14  C7   N3   C2   C3      0.00   0.0  0
 6T2  CONST_15  C7   C6   C4   C3      0.00   0.0  0
 6T2  CONST_16  C16  C6   C4   C3    180.00   0.0  0
 6T2  CONST_17  N1   C2   C3   C4    180.00   0.0  0
 6T2  CONST_18  N3   C2   C3   C4      0.00   0.0  0
 6T2  CONST_19  N3   C7   C6   C4      0.00   0.0  0
 6T2  CONST_20  C11  C7   C6   C4    180.00   0.0  0
 6T2  CONST_21  C15  C16  C6   C4    180.00   0.0  0
 6T2  CONST_22  C14  C11  C7   C6      0.00   0.0  0
 6T2  CONST_23  C14  C15  C16  C6      0.00   0.0  0
 6T2  CONST_24  N1   C2   N3   C7    180.00   0.0  0
 6T2  CONST_25  C15  C14  C11  C7      0.00   0.0  0
 6T2  CONST_26  C15  C16  C6   C7      0.00   0.0  0
 6T2  CONST_27  C13  C18  C19  C9      0.00   0.0  0
 6T2  CONST_28  C13  C12  C10  C9      0.00   0.0  0
 6T2  CONST_29  N2   C1   N1   C9      0.00   0.0  0
 6T2  CONST_31  C18  C13  C12  C10     0.00   0.0  0
 6T2  CONST_32  C18  C19  C9   C10     0.00   0.0  0
 6T2  CONST_33  N1   C1   N2   C10     0.00   0.0  0
 6T2  CONST_34  C16  C6   C7   C11     0.00   0.0  0
 6T2  CONST_35  C16  C15  C14  C11     0.00   0.0  0
 6T2  CONST_36  C19  C18  C13  C12     0.00   0.0  0
 6T2  CONST_37  C19  C9   C10  C12     0.00   0.0  0
 6T2  CONST_38  N1   C9   C10  C12   180.00   0.0  0
 6T2  CONST_39  N2   C10  C12  C13   180.00   0.0  0
 6T2  CONST_40  N3   C7   C11  C14   180.00   0.0  0
 6T2  CONST_41  C16  C6   C7   N3    180.00   0.0  0
 6T2  CONST_42  C18  C19  C9   N1    180.00   0.0  0
 6T2  CONST_43  N2   C10  C9   N1      0.00   0.0  0
 6T2  CONST_44  C19  C9   C10  N2    180.00   0.0  0
 6T2  CONST_45  N4   C11  C7   C6    180.00   0.0  0
 6T2  CONST_46  N4   C11  C14  C15   180.00   0.0  0
 6T2  CONST_47  N3   C7   C11  N4      0.00   0.0  0
 6T2  CONST_48  O1   C13  C12  C10   180.00   0.0  0
 6T2  CONST_49  O1   C13  C18  C19   180.00   0.0  0
 6T2  CONST_50  H1   C1   N1   C2      0.00   0.0  0
 6T2  CONST_51  H3   C4   C3   C2    180.00   0.0  0
 6T2  CONST_52  H21  C16  C6   C4      0.00   0.0  0
 6T2  CONST_53  H2   C3   C4   C6    180.00   0.0  0
 6T2  CONST_54  H8   C15  C16  C6    180.00   0.0  0
 6T2  CONST_55  H7   C14  C11  C7    180.00   0.0  0
 6T2  CONST_56  H23  C18  C19  C9    180.00   0.0  0
 6T2  CONST_57  H6   C12  C10  C9    180.00   0.0  0
 6T2  CONST_58  H22  C19  C9   C10   180.00   0.0  0
 6T2  Var_01    C30  N4   C11  C7    156.13  30.0  1
 6T2  Var_02    C40  C30  N4   C11  -166.28  30.0  1
 6T2  Var_03    C60  C70  N4   C11   167.71  30.0  1
 6T2  Var_04    N4   C30  C40  C50   -58.47  30.0  1
 6T2  Var_05    N4   C70  C60  C50    53.80  30.0  1
 6T2  Var_06    H29  C26  O2   C24  -111.59  30.0  1
 6T2  Var_07    H27  C24  O2   C26  -125.18  30.0  1
 6T2  Var_08    C18  C13  O1   C5      6.20  30.0  2
 6T2  Var_09    C23  C5   O1   C13   175.26  30.0  1

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
 6T2  chir_01  C50  N80  C40  C60  negativ
 6T2  chir_02  C23  C24  C26  C27  negativ

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
 6T2  plan-1  C1   0.020
 6T2  plan-1  C2   0.020
 6T2  plan-1  C9   0.020
 6T2  plan-1  C10  0.020
 6T2  plan-1  C12  0.020
 6T2  plan-1  C13  0.020
 6T2  plan-1  N1   0.020
 6T2  plan-1  N2   0.020
 6T2  plan-1  C19  0.020
 6T2  plan-1  C18  0.020
 6T2  plan-1  O1   0.020
 6T2  plan-1  H1   0.020
 6T2  plan-1  H6   0.020
 6T2  plan-1  H22  0.020
 6T2  plan-1  H23  0.020
 6T2  plan-2  C2   0.020
 6T2  plan-2  C3   0.020
 6T2  plan-2  C4   0.020
 6T2  plan-2  C6   0.020
 6T2  plan-2  C7   0.020
 6T2  plan-2  C11  0.020
 6T2  plan-2  C14  0.020
 6T2  plan-2  C15  0.020
 6T2  plan-2  N4   0.020
 6T2  plan-2  N3   0.020
 6T2  plan-2  C16  0.020
 6T2  plan-2  N1   0.020
 6T2  plan-2  H2   0.020
 6T2  plan-2  H3   0.020
 6T2  plan-2  H7   0.020
 6T2  plan-2  H8   0.020
 6T2  plan-2  H21  0.020

